RDKit 3D 47 50 0 0 0 0 0 0 0 0999 V2000 2.7807 2.5623 1.6042 C 0 0 0 0 0 3 0 0 0 0 0 0 2.2685 1.7713 0.9261 N 0 0 0 0 0 4 0 0 0 0 0 0 1.6583 0.7787 0.0960 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2620 0.4828 0.5250 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6491 1.6155 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5646 2.9932 0.2286 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7736 3.4961 -0.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6275 2.5064 -0.4137 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9501 2.3805 -0.8277 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4996 1.1118 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7670 -0.0450 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4836 0.1087 -0.3377 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9393 1.3395 -0.1823 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -1.0765 -0.0615 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0174 -1.5819 1.3176 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9538 -2.1016 -1.1319 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1718 -0.7645 -0.1644 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6480 -1.9049 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0467 -1.7184 -0.1825 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5938 -0.3526 -0.0005 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5345 -0.0855 -1.1867 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4961 -0.3389 1.2048 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7798 -0.6042 1.1212 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5753 1.2934 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2422 0.3447 1.6456 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3162 3.5580 0.4977 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9863 4.5006 -0.2379 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5018 3.2710 -1.0125 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5170 1.0226 -1.3025 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2035 -1.0174 -0.8637 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -2.5948 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5937 -0.8520 2.0487 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1188 -1.5108 1.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4468 -2.9976 -0.7031 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5827 -1.6780 -1.9472 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0322 -2.4790 -1.6395 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0557 -0.6388 -1.2581 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2475 -2.8456 -0.0925 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6278 -2.0047 1.4308 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6964 -2.4395 0.3552 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0625 -2.0322 -1.2566 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2219 0.7202 -0.9031 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8881 0.3263 -2.0163 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0322 -0.9983 -1.5261 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0283 -0.0971 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2029 -0.8431 0.1371 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3828 -0.5808 2.0165 H 0 0 0 0 0 0 0 0 0 0 0 0 21 20 1 0 20 19 1 0 19 18 1 0 18 17 1 0 17 4 1 0 4 3 1 0 3 2 1 0 2 1 3 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 14 16 1 0 20 22 1 1 22 23 2 3 3 20 1 0 13 5 1 0 14 17 1 0 13 8 1 0 21 42 1 0 21 43 1 0 21 44 1 0 19 40 1 0 19 41 1 0 18 38 1 0 18 39 1 0 17 37 1 6 4 25 1 1 3 24 1 6 6 26 1 0 7 27 1 0 9 28 1 0 10 29 1 0 11 30 1 0 15 31 1 0 15 32 1 0 15 33 1 0 16 34 1 0 16 35 1 0 16 36 1 0 22 45 1 0 23 46 1 0 23 47 1 0 M CHG 2 1 -1 2 1 M END